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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL85499
Molecular formula	C36H45N3O7
IUPAC name	1-[2-[3-(3,4-dimethoxyphenyl)-1-(3,4,5-trimethoxybenzoyl)pyrrolidin-3-yl]ethyl]-4-phenylpiperidine-4-carboxamide
Molecular weight	631.77
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	4.4
Synonyms	SCHEMBL8353159 1-[2-[3-(3,4-dimethoxy-phenyl)-1-(3,4,5-trimethoxy-benzoyl)-pyrrolidin-3-yl]-ethyl]-4-phenyl-piperidine-4-carboxylic acid amide BDBM50290296 FMTLSROFQVSZGR-UHFFFAOYSA-N 1-{2-[3-(3,4-Dimethoxy-phenyl)-1-(3,4,5-trimethoxy-benzoyl)-pyrrolidin-3-yl]-ethyl}-4-phenyl-piperidine-4-carboxylic acid amide
Inchi Key	FMTLSROFQVSZGR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C36H45N3O7/c1-42-28-12-11-27(23-29(28)43-2)35(13-17-38-18-15-36(16-19-38,34(37)41)26-9-7-6-8-10-26)14-20-39(24-35)33(40)25-21-30(44-3)32(46-5)31(22-25)45-4/h6-12,21-23H,13-20,24H2,1-5H3,(H2,37,41)
PubChem CID	44319249
ChEMBL	CHEMBL85499
IUPHAR	N/A
BindingDB	50290296
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
82252	Substance-K receptor	P30549	Tacr2	Mus musculus (Mouse)	384
82251	Substance-P receptor	P30547	TACR1	Cavia porcellus (Guinea pig)	407

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